Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PDE2A | O00408 | 4/20 | 0.36 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.35 |
| ▸ | GSK3B | P49841 | 1/20 | 0.35 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | KIF11 | P52732 | 1/20 | 0.33 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.32 |
| ▸ | MTOR | P42345 | 1/20 | 0.32 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.32 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.32 |
| ▸ | DAO | P14920 | 1/20 | 0.32 |
| ▸ | MEN1 | O00255 | 1/20 | 0.32 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.32 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | CES2 | O00748 | 1/20 | 0.32 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL27624247 | 0.85 | PDE2A (0.40) | PDE2ANOTUMTAS2R14MAPTKIF11 | |
| SCHEMBL6446889 | 0.81 | CES2 (0.43) | PDE2AGSK3BMAPTKIF11KDM4E | |
| SCHEMBL5608722 | 0.81 | IDO1 (0.43) | PDE2AGSK3BMEN1KMT2ACES2 | |
| SCHEMBL3248499 | 0.80 | PDE2A (0.42) | PDE2AGSK3BMCL1MEN1KMT2A | |
| SCHEMBL27624269 | 0.80 | PDE2A (0.35) | PDE2ANOTUMGSK3BTAS2R14MAPT | |
| SCHEMBL4963648 | 0.78 | PDE2A (0.51) | PDE2AGSK3B | |
| SCHEMBL20551557 | 0.78 | PDE2A (0.51) | PDE2AGSK3B | |
| SCHEMBL6443794 | 0.77 | HDAC4 (0.33) | MAPTKDM4EMEN1KMT2ACES2 | |
| SCHEMBL929896 | 0.77 | LMNA (0.38) | MEN1KMT2ACYP1A2 | |
| SCHEMBL12306470 | 0.74 | PDE2A (0.46) | PDE2ANOTUMTAS2R14KIF11 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1583742-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2005-10-12 | — | — | EP | disclosed |
| WO-2004060870-A1 | NOVEL CB 1 RECEPTOUR INVERSE AGONISTS | F. HOFFMANN-LA ROCHE AG (CH) | 2004-07-22 | — | — | WO | disclosed |